ethane;N'-methyl-N'-propylethane-1,2-diamine

C10H28N2 — CID 164863386

IUPACethane;N'-methyl-N'-propylethane-1,2-diamine
SMILESCC.CC.CCCN(C)CCN
InChIInChI=1S/C6H16N2.2C2H6/c1-3-5-8(2)6-4-7;2*1-2/h3-7H2,1-2H3;2*1-2H3
InChIKeyQYLNFCYQIYXNFF-UHFFFAOYSA-N
MW176.35 g/mol
LogP2.34
Rot. Bonds4

About ethane;N'-methyl-N'-propylethane-1,2-diamine

ethane;N'-methyl-N'-propylethane-1,2-diamine (PubChem CID 164863386) has the molecular formula C10H28N2 and a molecular weight of 176.35 g/mol. Its IUPAC name is ethane;N'-methyl-N'-propylethane-1,2-diamine.

Molecular Properties

Compound Nameethane;N'-methyl-N'-propylethane-1,2-diamine
PubChem CID164863386
Molecular FormulaC10H28N2
Molecular Weight176.35 g/mol
Exact Mass176.23
IUPAC Nameethane;N'-methyl-N'-propylethane-1,2-diamine
SMILESCC.CC.CCCN(C)CCN
InChIInChI=1S/C6H16N2.2C2H6/c1-3-5-8(2)6-4-7;2*1-2/h3-7H2,1-2H3;2*1-2H3
InChIKeyQYLNFCYQIYXNFF-UHFFFAOYSA-N
XLogP2.34
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500176.35
LogP ≤ 52.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N,N'-dimethyl-N'-[2-[methyl(propyl)amino]ethyl]-N-propylethane-1,2-diamine
CID 162082787
N'-methyl-N'-[2-[propyl-[2-(propylamino)ethyl]amino]ethyl]ethane-1,2-diamine
CID 169021905
N'-[2-[2-(dimethylamino)ethyl-methylamino]ethyl]-N'-methylethane-1,2-diamine;N'-[2-(dimethylamino)ethyl]-N'-methylethane-1,2-diamine
CID 23499637
ethane;3-fluoro-N-methyl-N-propylpropan-1-amine
CID 142123052
N'-[2-[2-[methyl(propyl)amino]ethylamino]ethyl]ethane-1,2-diamine
CID 154558458
3-(2-aminoethoxy)-N-methyl-N-propylpropan-1-amine
CID 171838408
N',2,2-trimethyl-N'-propylpentane-1,5-diamine
CID 65254018
N'-(2-aminoethyl)-N'-methylpentane-1,5-diamine
CID 57004343
N'-[2-(diiodoamino)ethyl]-N'-methylethane-1,2-diamine
CID 145464641
N'-(3-fluoropropyl)-N'-methylethane-1,2-diamine
CID 81106784
N',2,2-trimethyl-N'-propylbutane-1,4-diamine
CID 65246982
N'-[2-[2-[butyl(methyl)amino]ethyl-methylamino]ethyl]-N'-methylpropane-1,3-diamine
CID 167586856

Frequently Asked Questions

What is the IUPAC name of ethane;N'-methyl-N'-propylethane-1,2-diamine?
The IUPAC name of ethane;N'-methyl-N'-propylethane-1,2-diamine (CID 164863386) is ethane;N'-methyl-N'-propylethane-1,2-diamine.
What is the SMILES notation for ethane;N'-methyl-N'-propylethane-1,2-diamine?
The canonical SMILES for ethane;N'-methyl-N'-propylethane-1,2-diamine is CC.CC.CCCN(C)CCN.
What is the InChIKey of ethane;N'-methyl-N'-propylethane-1,2-diamine?
The InChIKey is QYLNFCYQIYXNFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H16N2.2C2H6/c1-3-5-8(2)6-4-7;2*1-2/h3-7H2,1-2H3;2*1-2H3.
What are the key properties of ethane;N'-methyl-N'-propylethane-1,2-diamine?
ethane;N'-methyl-N'-propylethane-1,2-diamine has a molecular weight of 176.35 g/mol, XLogP of 2.34, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;N'-methyl-N'-propylethane-1,2-diamine is sourced from PubChem (CID 164863386), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).